SCHEMBL14180943

SCHEMBL14180943

O=c1n(CC(O)c2ccc(Cl)cc2)nc2c(-c3ccc(Cl)cc3)c(-c3ccc(Cl)cc3)cnn12

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 3/20 0.52
▸ RAB9A P51151 6/20 0.37
▸ MAPT P10636 4/20 0.37
▸ NPC1 O15118 4/20 0.37
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ KDM4E B2RXH2 3/20 0.37
▸ ALDH1A1 P00352 3/20 0.37
▸ GPR119 Q8TDV5 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ GPR139 Q6DWJ6 2/20 0.36
▸ HCAR2 Q8TDS4 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL14180959 0.95 CNR1 (0.50) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL14180941 0.95 CNR1 (0.49) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL4804804 0.91 CNR1 (0.50) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL4804792 0.91 CNR1 (0.50) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL14180759 0.86 CNR1 (0.53) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL14180944 0.86 CNR1 (0.56) CNR1
SCHEMBL14180961 0.84 CNR1 (0.48) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL14180963 0.84 CNR1 (0.48) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL4803516 0.83 CNR1 (0.49) CNR1RAB9AMAPTNPC1SMN1; SMN2
SCHEMBL4804647 0.83 CNR1 (0.47) CNR1RAB9AMAPTNPC1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
US-7378418-B2 Azabicyclic heterocycles as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2008-05-27 — — US disclosed
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